Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEQQVISFLNENYPLHIHTAKAVTNEMYRCIDDQGTYYARITNYKPYEEQLEEVSWTNALYREGVG-VAPAIPSCRGQIVELMPPKDIIVVVYKAAPGIHLPRGE---------------WNADVLAELGRQIGRMHRITQSYEANHRLHHLGDWHDQEEYNFE-QYIPAEETAIRAIAANVLAEVKKLPRERATYGLIHGDLWLENILVDRGSSLTMIDFQDCEK---------HYYMYDLAVPLYSALEF-SF-A-G-----------AGNIRDYGISIANALLEGYQEEHTLDPEM-LKQLPLFLKLKEIFEYNLMNMYWDRERLSEEQIRIMNLYRLRIEHHVQLLEWD 4WZY Chain:A ((135-420)) ----------------------QSNTSVIF--G-KDAMLKVFRRV-TPGINPDIELNRVLAQAGNRHVARLLGSFETSWAGPGTDRCALGMVTAFAANSAEGWDMATASAREMFADVVGSDFADESYRLGNAVASVHATLAEALGTST----EPFPVDTVLARLQSAAR-SAPELAGRAAAVEERYRRLDGRAITVQRVHGDLHLGQVLRTPD-DWLLIDFEGEPGQPLDERRRPDSPLRDVAGVLRSFEYAAYQKLVELAPEQDADGRLADRARNWVDRNSAAFCAGYAAVAGDDPRRDGDVLAAYELDKAVYEAAY-----------------------------------

General information: TITO was launched using: RESULT: Template: 4WZY.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 964 -3236 -3.36 -13.21 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -3.36 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.334

(partial model without unconserved sides chains): PDB file : Tito_4WZY.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4wzy-query.scw PDB file : Tito_Scwrl_4WZY.pdb: